Vitas-M small molecule compound
ethyl 4-({[(2'S,3R,7a'S)-5-chloro-2-oxo-1,1',2,2',5',6',7',7a'-octahydrospiro[indole-3,3'-pyrrolizin]-2'-yl]carbonyl}amino)benzoate
Catalog ID
STK614515
SMILES CCOC(=O)c1ccc(cc1)NC(=O)[C@H]1C[C@H]2N([C@@]31C(=O)Nc1c3cc(Cl)cc1)CCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C24H24ClN3O4 MW 453.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24ClN3O4/c1-2-32-22(30)14-5-8-16(9-6-14)26-21(29)19-13-17-4-3-11-28(17)24(19)18-12-15(25)7-10-20(18)27-23(24)31/h5-10,12,17,19H,2-4,11,13H2,1H3,(H,26,29)(H,27,31)/t17-,19+,24-/m0/s1InChIKey
FBWUMPSUZLKLAE-PDOGEWKWSA-NSynonyms
1014042-15-91014042159
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC3CCCN3C24C5=C(C=CC(=C5)Cl)NC4=O
CCOC(=O)c1ccc(cc1)NC(=O)(C@H)1C(C@H)2N((C@@)31C(=O)Nc1c3cc(Cl)cc1)CCC2
ethyl4((((2S3R7aS)5chloro2oxo11225677aoctahydrospiro(indole33pyrrolizin)2yl)carbonyl)amino)benzoate
ethyl4(((2S3R8S)5chloro2oxospiro(125678hexahydropyrrolizine331Hindole)2carbonyl)amino)benzoate
ethyl4((2S3R7aS)5chloro2oxo125677ahexahydrospiro(indoline33pyrrolizin)2ylcarboxamido)benzoate
InChI=1SC24H24ClN3O4c123222(30)145816(9614)2621(29)191317431128(17)24(19)181215(25)71020(18)2723(24)31h510121719H241113H21H3(H2629)(H2731)t1719+24m0s1
MFCD08284733
ZINC000057142899
ZINC57142899
Check stock
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Check stock on Vitas-MAvailable files
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